Butyl benzenesulfonate

CAS Registry Number®

80-44-4

CAS Name

Butyl benzenesulfonate

Molecular Formula

C10H14O3S

Molecular Mass

214.28

Cite this Page

Butyl benzenesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=80-44-4 (retrieved 2024-11-22) (CAS RN: 80-44-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    147-149 °C @ Press: 4 Torr

  • Density (1)

    1.148 g/cm³ @ Temp: 25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H14O3S/c1-2-3-9-13-14(11,12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3

InChIKey

InChIKey=NIKBCKTWWPVAIC-UHFFFAOYSA-N

SMILES

S(OCCCC)(=O)(=O)C1=CC=CC=C1

Canonical SMILES

O=S(=O)(OCCCC)C=1C=CC=CC1

Other Names for this Substance

  • Benzenesulfonic acid, butyl ester
  • Butyl benzenesulfonate
  • NSC 3215

CAS INSIGHTSTM
Targeted protein degrader structure, illustration